%chk=000088129.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088129

0 1
 O  -5.4099999E-02   1.136100       1.463600    
 O  -7.5800002E-02   3.218100     -0.2429000    
 N  -3.1800002E-02   1.898400     -0.7120000    
 C   2.0000000E-02 -0.5054000     -0.2928000    
 C    1.295500      -1.244700      0.1563000    
 C   -1.233700      -1.305400      0.1116000    
 C    2.574300     -0.5904000     -0.3760000    
 C   -2.529800     -0.6694000     -0.4003000    
 C  -2.4900001E-02  0.9232000      0.2514000    
 C    3.809000      -1.388800      1.2500000E-02
 C   -3.748700      -1.471800      2.8500000E-02
 H   3.5300002E-02 -0.4579000      -1.390500    
 H    1.338400      -1.282000       1.252300    
 H    1.253900      -2.282800     -0.1969000    
 H   -1.156800      -2.327000     -0.2810000    
 H   -1.280700      -1.386300       1.205300    
 H    2.673400      0.4273000      1.7500000E-02
 H    2.526200     -0.5144000      -1.468500    
 H   -2.635600      0.3513000     -1.7000001E-02
 H   -2.504800     -0.6058000      -1.494300    
 H    4.710700     -0.9048000     -0.3753000    
 H    3.902900      -1.460700       1.100800    
 H    3.765600      -2.403200     -0.3968000    
 H   -3.819900      -1.524200       1.119700    
 H   -3.703400      -2.493100     -0.3628000    
 H   -4.662900      -1.003500     -0.3495000    
 H   7.3200002E-02   1.762200      -1.711000    
 H   0.5070000       3.652000     -0.8886000    


%chk=000088129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088129

0 1
O 0.032476 1.330545 1.273325
O 0.018088 3.277107 -0.517263
N 0.023199 1.896813 -0.928812
C 0.035778 -0.521150 -0.394715
C 1.326816 -1.218219 0.120231
C -1.244126 -1.230843 0.130994
C 2.634795 -0.645735 -0.470068
C -2.562349 -0.672371 -0.449893
C 0.030265 0.937494 0.050616
C 3.884765 -1.399194 0.033617
C -3.800888 -1.435609 0.067069
H 0.031385 -0.557590 -1.506619
H 1.350520 -1.132834 1.224250
H 1.256416 -2.298244 -0.121078
H -1.164713 -2.310366 -0.109651
H -1.260048 -1.144218 1.235053
H 2.722739 0.426553 -0.205831
H 2.593488 -0.696508 -1.578148
H -2.657847 0.399951 -0.188433
H -2.529981 -0.726538 -1.558094
H 4.811033 -0.977896 -0.397847
H 3.965498 -1.335357 1.134783
H 3.841103 -2.470830 -0.238610
H -3.872934 -1.368319 1.168623
H -3.749469 -2.507835 -0.201468
H -4.734698 -1.024724 -0.358149
H 0.019572 1.792763 -1.941240
H 0.021618 3.160153 0.490659


